# generated using pymatgen
data_NiBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37565700
_cell_length_b   5.73356300
_cell_length_c   7.74435300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiBiO3
_chemical_formula_sum   'Ni4 Bi4 O12'
_cell_volume   238.69387763
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ni  Ni0  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni1  1  0.50000000  0.00000000  0.50000000  1.0
  Ni  Ni2  1  0.00000000  0.50000000  0.00000000  1.0
  Ni  Ni3  1  0.50000000  0.00000000  0.00000000  1.0
  Bi  Bi4  1  0.51870800  0.56549100  0.75000000  1.0
  Bi  Bi5  1  0.48129200  0.43450900  0.25000000  1.0
  Bi  Bi6  1  0.01870800  0.93450900  0.25000000  1.0
  Bi  Bi7  1  0.98129200  0.06549100  0.75000000  1.0
  O  O8  1  0.68199800  0.31398000  0.55992100  1.0
  O  O9  1  0.31800200  0.68602000  0.44007900  1.0
  O  O10  1  0.18199800  0.18602000  0.44007900  1.0
  O  O11  1  0.81800200  0.81398000  0.55992100  1.0
  O  O12  1  0.31800200  0.68602000  0.05992100  1.0
  O  O13  1  0.68199800  0.31398000  0.94007900  1.0
  O  O14  1  0.81800200  0.81398000  0.94007900  1.0
  O  O15  1  0.18199800  0.18602000  0.05992100  1.0
  O  O16  1  0.13042700  0.44267900  0.75000000  1.0
  O  O17  1  0.86957300  0.55732100  0.25000000  1.0
  O  O18  1  0.63042700  0.05732100  0.25000000  1.0
  O  O19  1  0.36957300  0.94267900  0.75000000  1.0